CIV_1.1
AlkaPlorer ID: AK002229
Synonym: None
IUPAC Name: (1R,3R)-5-[5-hydroxy-6-[1-hydroxy-4-[(1R,3R)-6-hydroxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-5-yl]-8-methoxy-6-methylnaphthalen-2-yl]-4-methoxy-2-methylnaphthalen-1-yl]-1,3-dimethyl-1,2,3,4-tetrahydroisoquinoline-6,8-diol
Structure
SMILES: COC1=CC(C)=CC2=C(C3=C(O)C=CC4=C3C[C@@H](C)N[C@@H]4C)C=C(C3=CC=C4C(C5=C(O)C=C(O)C6=C5C[C@@H](C)N[C@@H]6C)=C(C)C=C(OC)C4=C3O)C(O)=C12
InChI: InChI=1S/C46H48N2O7/c1-20-13-29-31(41-30-16-22(3)47-24(5)26(30)11-12-34(41)49)18-32(46(53)44(29)37(14-20)54-7)27-9-10-28-39(21(2)15-38(55-8)43(28)45(27)52)42-33-17-23(4)48-25(6)40(33)35(50)19-36(42)51/h9-15,18-19,22-25,47-53H,16-17H2,1-8H3/t22-,23-,24-,25-/m1/s1
InChIKey: RDXPFZFFRMIUEF-ZGFBMJKBSA-N
Reference
Carotenoids and their metabolism in the goldfish Carassius auratus (Hibuna)
Animal Carotenoids. 4. The Carotenoids of Asterias rubens - Asterinsäure.
PubChem CID: 162818567
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
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Properties Information
Molecule Weight: 740.8970000000002
TPSA？: 143.67000000000002
MolLogP？: 9.34644
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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